arXiv subjects

W. M. C. Sameera

Publications and source records attributed to W. M. C. Sameera.

8 recordsLinked to original sources

arXiv2026

Efficient Interstellar Grain Growth from High Sticking Coefficients on Amorphous Carbon Dust

Cosmic dust is the solid phase of the interstellar medium (ISM), classically assumed to be composed of carbonaceous and silicate grains with size distributions spanning $\sim 5~Å$ to $\sim 1~μ$m (Weingartner & Draine 2001, Draine & Li 2007, Hensley & Draine 2023). While it constitutes at most order-of-magnitude $\mathbf{1\%}$ of the ISM mass, dust is second only to stars in importance for the observable properties of galaxies (Zavala et al. 2021). Large uncertainties in the efficiency of grain growth obfuscate the relative contribution of the two dominant sources of dust in the Universe: direct production from evolved stars versus gas-phase accretion in the ambient ISM (Feldmann 2015, Esmerian & Gnedin 2022, Esmerian & Gnedin 2024). Advances in supercomputers have only recently allowed us to move beyond simple, idealized predictions of dust grain growth efficiencies (Leitch-Devlin & Williams 1985) with atomistic dynamical calculations (Bossion et al. 2024). We show that small carbon dust grains can grow significantly on timescales much shorter than the age of the universe and, in some ISM phases, comparable to the lifetimes of giant molecular clouds. Specifically, we perform molecular dynamics simulations of an amorphous carbon (a-C) grain surface impacted by gas-phase atoms of cosmologically abundant elements with realistic interstellar conditions, finding high ($\gtrsim 0.2$) sticking coefficients for all non-inert elements at all relevant gas and grain temperatures. We present the results of experiments conducted on similar dust candidate materials that support our theoretical calculations. Our results therefore confirm that the process of gas-phase accretion onto grains is likely an efficient mechanism for the growth of interstellar dust mass on astrophysical timescales, and plausibly central to the evolutionary life-cycle of interstellar grains at all cosmic epochs. (abridged)

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arXiv2026

Silicate cosmic dust grain collisions in the interstellar medium: A molecular dynamics study

(abridged) We aim to predict the most important parameters for grain-grain collision outcomes for models of interstellar grain population evolution on astrophysical scales: the threshold velocity above which colliding grains shatter, the threshold for vaporization, and resulting distributions of grain sizes. We use molecular dynamics simulations which evolve the dynamics of each atom in a dust grain to explore the outcomes of collisions between silicate grains of radii $a \in [5,50]~Å$ at velocities $0.1-20$ km/s. We run simulations of grains with two materials: amorphous SiO$_2$ and an amorphous silicate of composition suggested by Draine \& Hensley (2021). With these simulations, we quantify the collision velocity dependence of shattered and vaporized mass fractions, and the resulting size distributions of shattering products. We find grain shattering thresholds are $\sim$6 km/s for both amorphous SiO$_2$ and astrodust material, which is a factor of $\sim$2 higher than the canonical value for silicates of 2.7 km/s from Jones et al. (1996). This discrepancy is mostly alleviated by correcting an error in the expression for these velocity thresholds derived in Tielens et al. (1994). We find that the size distributions of shattered products are generally not consistent with the power law distributions predicted by this previous model. We also find that their expression fails to predict the fraction of shattered or vaporized material observed in our numerical simulations. The model of Hirashita \& Kobayashi (2013) for the same quantities similarly fails to match the simulations. We provide updated shattering velocity thresholds for candidate grain materials. Broadly, our updated threshold velocity prescription suggests that astrophysical dust grains, particularly those composed of silicate materials, may be more robust to shattering in the interstellar medium than previously assumed.

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arXiv2025

A warm ultra-luminous infrared galaxy just 600 million years after the Big Bang

We present an Atacama Large Millimeter/submillimeter Array (ALMA) Band 9 continuum detection ($3.3 σ$) of MACS0416_Y1 that confirms the suspected warm dust (91$^{+62}_{-35}$ K) of this Lyman-Break Galaxy (LBG) at $z = 8.3$ with $\log_{10} M_{\ast}/$M$_{\odot} = 9.0 \pm 0.1$. A modified black-body fit to the ALMA Bands 3 through 9 data of MACS0416_Y1 finds an intrinsic infrared luminosity of 1.0$^{+1.8}_{-0.6} \times{} 10^{12}\ \mathrm{L_{\odot}}$, placing this UV-selected LBG in the regime of Ultra Luminous Infrared Galaxies (ULIRGs). Its luminous but modest dust reservoir (1.4$^{+1.3}_{-0.5} \times{} 10^{6}\ \mathrm{M_{\odot}}$) is co-spatial to regions with a UV-continuum slope $β_{\rm UV} \approx -1.5$ as seen by James Webb Space Telescope (JWST) imaging. Although this implies some dust obscuration, the JWST photometry implies less obscured star formation than seen in the complete characterization by ALMA, implying some spatial separation of dust and stars on scales below 200 pc, i.e., smaller than those probed by JWST and ALMA. This source is an extreme example of dust-obscured star formation contributing strongly to the cosmic build-up of stellar mass, which can only be revealed through direct and comprehensive observations in the (sub)mm regime.

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arXiv2025

The Binding Energies of Atoms on Amorphous Silicate Dust: A Computational Study

Context. We investigate the binding energies of atoms to interstellar dust particles, which play a key role in their growth and evolution, as well as for the chemical reactions on their surfaces. Aims. We aim to compute the binding energies of abundant atoms in the interstellar medium (C, N, O, Mg, Al, Si, S, Ca, Fe, and Ni) to silicate dust. Methods. We used the Geometries, Frequencies, and Non-covalent Interactions Tight Binding (GFN1-xTB) method to compute the binding energies. An FeMgSiO$_4$ periodic surface model, containing 81 local minima on the surface, was used. Results. A range of binding energies was found for each element. The median of the binding energies follows the order Si (14.8 eV) > Al (12.8 eV) > Ca (12.7 eV) > C (9.5 eV) > O (8.1 eV) > N (6.2 eV) > Fe (6.0 eV) > S (5.2 eV) > Mg (2.4 eV). The probability distribution of binding energies for each element except Ca is statistically consistent with a log-normal distribution. Conclusions. In general, Si, Ca, and Al atoms have large binding energies. Thus, these atoms can stay on the silicate dust particles at high temperatures. The binding energies of the other atoms, C, N, O, Mg, S, Fe and Ni, are relatively weak. However, the computed binding energies for these elements are still far stronger than the energies associated with dust temperatures typical of the ambient interstellar medium (ISM), suggesting that silicate grains are generally stable against sublimation. We estimate sublimation temperatures for silicate grains to range from 1600 K to 3000K depending on assumed grain size and lifetime. These binding energies on silicate dust grains, estimated from first principles for the first time, provide invaluable input to models of dust evolution and dust-catalyzed chemical reactions in the interstellar medium.

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arXiv2024

Chemical pathways of SO2 with hydrogen atoms on interstellar ice analogues

Sulfur dioxide (SO2) is a sulfur-containing molecule expected to exist as a solid in the interstellar medium (ISM). In this study, we performed laboratory experiments and computational analyses on the surface reactions of solid SO2 with hydrogen atoms on amorphous solid water (ASW) at low temperatures. After 40 min of exposure of SO2 deposited on ASW to H atoms, approximately 80% of the solid SO2 was lost from the substrate at 10-40 K, and approximately 50% even at 60 K, without any definite detection of reaction products. Quantum chemical calculations suggest that H atoms preferentially add to the S atom of solid SO2, forming the HSO2 radical. Further reactions of the HSO2 radical with H atoms result in the formation of several S-bearing species, including HS(O)OH, the S(O)OH radical, HO-S-OH, HS-OH, and H2S. In codeposition experiments involving H and SO2, we confirmed the formation of H2S, HS(O)OH, and/or HO-S-OH. However, the yields of these S-bearing species were insufficient to account for the complete loss of the initial SO2 reactant. These findings suggest that some products desorbed into the gas phase upon formation. This study indicates that a portion of SO2 in ice mantles may remain unreacted, avoiding hydrogenation, while the remainder is converted into other species, some of which may be subject to chemical desorption.

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arXiv2023

Determination of the branching ratio of CH$_3$OH + OH reaction on water ice surface at 10 K

The CH$_3$O and CH$_2$OH radicals can be important precursors of complex organic molecules (COMs) in interstellar dust. The COMs presumably originating from these radicals were abundantly found in various astronomical objects. Because each radical leads to different types of COMs, determining the abundance ratio of CH$_3$O to CH$_2$OH is crucial for a better understanding of the chemical evolution to various COMs. Recent work suggested that the reaction between CH$_3$OH and OH on ice dust plays an important role in forming CH$_3$O and CH$_2$OH radicals. However, quantitative details on the abundance of these radicals have not been presented to date. Herein, we experimentally determined the branching ratio (CH$_3$O/CH$_2$OH) resulting from the CH$_3$OH + OH reaction on the water ice surface at 10 K to be 4.3 $\pm$ 0.6. Furthermore, the CH$_3$O product in the reaction would participate in subsequent diffusive reactions even at a temperature as low as 10 K. This fact should provide critical information for COMs formation models in cold molecular clouds.

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arXiv2023

Methanol formation through reaction of low energy $CH_{3}^{+}$ ions with an amorphous solid water surface at low temperature

We have performed experimental investigations of methanol formation via the reactions of low energy $CH_{3}^{+}$ ions with an amorphous solid water (ASW) surface around 10 K. A newly developed experimental apparatus enabled irradiation of the ASW surface by several eV ions and detection of trace amounts of reaction products on the surface. It was found that methanol molecules were produced by low-energy $CH_{3}^{+}$ irradiation of the ASW surface and that hydroxy groups in produced methanol originated from water molecules in ASW, as predicted in a previous theoretical study. Little temperature dependence of observed methanol intensity is apparent in the temperature range 12 - 60 K. Ab-initio molecular dynamics simulations under constant temperature conditions of 10 K suggested that this reaction spontaneously produced a methanol molecule and an $H_{3}O^{+}$ ion, regardless of the contact point of $CH_{3}^{+}$ on the ASW surface. We have performed simulation with an astrochemical model under molecular-cloud conditions, where the reaction between $CH_{3}^{+}$ and $H_{2}O$ ice, leading to methanol formation, was included. We found that the impact of the reaction on methanol abundance was limited only at the edge of the molecular cloud (< 1 mag) because of the low abundance of $CH_{3}^{+}$ in the gas phase, whereas the reaction between the abundant molecular ion $HCO^{+}$ and $H_{2}O$ ice, which has not yet been confirmed experimentally, can considerably affect the abundance of a complex organic molecule. This work sheds light on a new type of reaction between molecular ions and ice surfaces that should be included in astrochemical models.

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arXiv2021

Successive H-atom addition to solid OCS on compact amorphous solid water

Carbonyl sulfide (OCS) is an abundant sulfur (S)-bearing species in the interstellar medium. It is present not only in the gas phase, but also on interstellar grains as a solid; therefore, OCS very likely undergoes physicochemical processes on icy surfaces at very low temperatures. The present study experimentally and computationally investigates the reaction of solid OCS with hydrogen (H) atoms on amorphous solid water at low temperatures. The results show that the addition of H to OCS proceeds via quantum tunneling, and further addition of H leads to the formation of carbon monoxide (CO), hydrogen sulfide (H2S), formaldehyde (H2CO), methanol (CH3OH) and thioformic acid (HC(O)SH). These experimental results are explained by our quantum chemical calculations, which demonstrate that the initial addition of H to the S atom of OCS is the most predominant, leading to the formation of OCS-H radicals. Once the formed OCS-H radical is stabilized on ice, further addition of H to the S atom yields CO and H2S, while that to the C atom yields HC(O)SH. We have also confirmed, in a separate experiment, the HC(O)SH formation by the HCO reactions with the SH radicals. The present results would have an important implication for the recent detection of HC(O)SH toward G+0.693-0.027.

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